Zobrazeno 1 - 10 of 93 pro vyhledávání: '"Richard D, Taylor"'
1
Elektronická kniha
Beyond Broadband Access : Developing Data-Based Information Policy Strategies
Autor: Richard D. Taylor, Amit M. Schejter
After broadband access, what next? What role do metrics play in understanding “information societies”? And, more important, in shaping their policies? Beyond counting people with broadband access, how can economic and social metrics inform broadb
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3
Akademický článek
Higher Affinity Antibodies Bind With Lower Hydration and Flexibility in Large Scale Simulations
Autor: Mabel T. Y. Wong, Sebastian Kelm, Xiaofeng Liu, Richard D. Taylor, Terry Baker, Jonathan W. Essex
Publikováno v: Frontiers in Immunology, Vol 13 (2022)
We have carried out a long-timescale simulation study on crystal structures of nine antibody-antigen pairs, in antigen-bound and antibody-only forms, using molecular dynamics with enhanced sampling and an explicit water model to explore interface con
Externí odkaz: https://doaj.org/article/9c8442dbe84e4fc28e2f66dd4fdc1822
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5
Water networks in complexes between proteins and FDA-approved drugs
Autor: Marley L. Samways, Hannah E. Bruce Macdonald, Richard D. Taylor, Jonathan W. Essex
Water molecules at protein-ligand interfaces are often of significant pharmaceutical interest, owing in part to the entropy which can be released upon the displacement of an ordered water by a therapeutic compound. Protein structures may not, however
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bcc5fa59646c1eb0d1c3ba24e6e254ec
https://eprints.soton.ac.uk/475722/
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7
Akademický článek
Insight into small molecule binding to the neonatal Fc receptor by X-ray crystallography and 100 kHz magic-angle-spinning NMR.
Autor: Daniel Stöppler, Alex Macpherson, Susanne Smith-Penzel, Nicolas Basse, Fabien Lecomte, Hervé Deboves, Richard D Taylor, Tim Norman, John Porter, Lorna C Waters, Marta Westwood, Ben Cossins, Katharine Cain, James White, Robert Griffin, Christine Prosser, Sebastian Kelm, Amy H Sullivan, David Fox, Mark D Carr, Alistair Henry, Richard Taylor, Beat H Meier, Hartmut Oschkinat, Alastair D Lawson
Publikováno v: PLoS Biology, Vol 16, Iss 5, p e2006192 (2018)
Aiming at the design of an allosteric modulator of the neonatal Fc receptor (FcRn)-Immunoglobulin G (IgG) interaction, we developed a new methodology including NMR fragment screening, X-ray crystallography, and magic-angle-spinning (MAS) NMR at 100 k
Externí odkaz: https://doaj.org/article/8aa07cda1edf4eacba469577557c2556
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8
Water molecules at protein–drug interfaces: computational prediction and analysis methods
Autor: Hannah E. Bruce Macdonald, Jonathan W. Essex, Marley L. Samways, Richard D. Taylor
Publikováno v: Chemical Society Reviews. 50:9104-9120
The fundamental importance of water molecules at drug-protein interfaces is now widely recognised and a significant feature in structure-based drug design. Experimental methods for analysing the role of water in drug binding have many challenges, inc
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a8d0d8db86ae7b1c0d3956dc019dff73
https://doi.org/10.1039/d0cs00151a
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9
Rings in Clinical Trials and Drugs: Present and Future
Autor: Jonathan Shearer, Jose L. Castro, Alastair D. G. Lawson, Malcolm MacCoss, Richard D. Taylor
Publikováno v: Journal of medicinal chemistry. 65(13)
We present a comprehensive analysis of all ring systems (both heterocyclic and nonheterocyclic) in clinical trial compounds and FDA-approved drugs. We show 67% of small molecules in clinical trials comprise only ring systems found in marketed drugs,
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::23900d745a91787bb1f42d731c0484d5
https://pubmed.ncbi.nlm.nih.gov/35730680
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